β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]-
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β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]-
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CAS No:
127745-41-9
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Formula:
C30H42N6O6S
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Chemical Name:
β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]-
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Synonyms:
β-Alanine,N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-,[3aS-(3aα,4β,6aα)]-;1H-Thieno[3,4-d]imidazole,β-alanine deriv.
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CAS No:
β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]- Basic Attributes
614.75600
614.76
Computed Properties
Molecular Weight:614.8
XLogP3:2.1
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:16
Exact Mass:614.28865425
Monoisotopic Mass:614.28865425
Topological Polar Surface Area:207
Heavy Atom Count:43
Complexity:1010
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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